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CHEBI:216087 - Armochaetoglasin H

ChEBI IDCHEBI:216087
ChEBI NameArmochaetoglasin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H36N2O6
Net Charge0
Average Mass544.648
Monoisotopic Mass544.25734
SMILESC/C1=C\[C@@H](C)C/C=C/[C@H]2[C@@H]3O[C@]3(C)[C@@H](C)[C@H]3[C@H](CC45OC4Nc4ccccc45)NC(=O)[C@]32C(=O)CCC(=O)C1=O
InChIInChI=1S/C32H36N2O6/c1-16-8-7-10-20-27-30(4,39-27)18(3)25-22(15-31-19-9-5-6-11-21(19)34-29(31)40-31)33-28(38)32(20,25)24(36)13-12-23(35)26(37)17(2)14-16/h5-7,9-11,14,16,18,20,22,25,27,29,34H,8,12-13,15H2,1-4H3,(H,33,38)/b10-7+,17-14+/t16-,18-,20-,22-,25-,27-,29?,30+,31?,32+/m0/s1
InChIKeyFVRJOQMWAMTJEP-ZKSPZHQYSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - PubMed (30268043)
ChEBI Ontology
Outgoing Relation(s)
Armochaetoglasin H (CHEBI:216087) is a indoles (CHEBI:24828)
IUPAC Name 
(1R,7E,9S,11E,13R,14S,16R,17S,18R,19S)-19-(1a,2-dihydrooxireno[2,3-b]indol-6b-ylmethyl)-7,9,16,17-tetramethyl-15-oxa-20-azatetracyclo[11.8.0.01,18.014,16]henicosa-7,11-diene-2,5,6,21-tetrone